N-butyl-2-[4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide

Systemtic Name: N-butyl-2-[4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide Openeye Name: N-butyl-2-[4-(2,5-dimethyl-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: N-butyl-2-[[4-(2,5-dimethyl-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N-butyl-2-[4-(2,5-dimethyl-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: N-butyl-2-[4-(N-mesyl-2,5-dimethyl-anilino)butanoylamino]benzamide Formula: C24H33N3O4S MolecularWeight: 459.60152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C24H33N3O4S/c1-5-6-15-25-24(29)20-10-7-8-11-21(20)26-23(28)12-9-16-27(32(4,30)31)22-17-18(2)13-14-19(22)3/h7-8,10-11,13-14,17H,5-6,9,12,15-16H2,1-4H3,(H,25,29)(H,26,28)